(2E)-4,4-dimethyl-3-oxidanylidene-2-[(2-propan-2-yloxyphenyl)methylidene]pentanenitrile

Systemtic Name: (2E)-4,4-dimethyl-3-oxidanylidene-2-[(2-propan-2-yloxyphenyl)methylidene]pentanenitrile Openeye Name: (2E)-2-[(2-isopropoxyphenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-4,4-dimethyl-3-oxo-2-[(2-propan-2-yloxyphenyl)methylidene]pentanenitrile IUPAC Name: (2E)-4,4-dimethyl-3-oxo-2-[(2-propan-2-yloxyphenyl)methylidene]pentanenitrile Traditional Name: (E)-3-(2-isopropoxyphenyl)-2-pivaloyl-acrylonitrile Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C=C(C#N)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)OC1=CC=CC=C1/C=C(\C#N)/C(=O)C(C)(C)C

InChI

InChI=1S/C17H21NO2/c1-12(2)20-15-9-7-6-8-13(15)10-14(11-18)16(19)17(3,4)5/h6-10,12H,1-5H3/b14-10+